Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | GSK3B | P49841 | 4/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | RECQL | P46063 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.46 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | ATM | Q13315 | 1/20 | 0.45 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL11248919 | 0.88 | PTGDR2 (0.50) | ALDH1A1NPSR1KDM4EKMT2ALMNA | |
| SCHEMBL11242309 | 0.87 | SLC2A2 (0.51) | ALDH1A1NPSR1CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL11251973 | 0.84 | RPA1 (0.50) | ALDH1A1NPSR1CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL4161662 | 0.83 | MEN1 (0.54) | ALDH1A1NPSR1CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL11240983 | 0.83 | KMT2A (0.52) | ALDH1A1NPSR1CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL7995963 | 0.81 | PTGS1 (0.52) | ALDH1A1NPSR1CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL11731366 | 0.80 | HPGD (0.54) | ALDH1A1NPSR1CYP2C9CYP2C19KDM4E | |
| SCHEMBL6123566 | 0.80 | ALDH1A1 (0.61) | ALDH1A1NPSR1GSK3BCYP3A4CYP2C9 | |
| SCHEMBL1997120 | 0.80 | ALDH1A1 (0.53) | ALDH1A1NPSR1CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL11247071 | 0.80 | KMT2A (0.49) | ALDH1A1NPSR1KMT2ALMNAFAAH |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4325962-A | ANTIINFLAMMATORY AGENTS, ANALGESICS, ANTIDYRETICS | BYK-GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) | 1982-04-20 | — | — | US | disclosed |
| US-4146721-A | ANALGESICS, ANTIINFLAMMATORY AGENTS AND ANTIPYRETICS | BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) | 1979-03-27 | — | — | US | disclosed |